Information card for entry 1550143

Structure parameters

• Formula: C24 H22 N2 O4 Pd
• Calculated formula: C24 H22 N2 O4 Pd
• SMILES: [Pd]1(N(C2C(=[O]1)c1ccccc1C(=O)C=2)c1c(OC)cccc1OC)([n]1ccccc1)C
• Title of publication: Efficient ethylene copolymerization with polar monomers using palladium anilinonaphthoquinone catalysts
• Authors of publication: Ding, Lin; Cheng, Hailong; Li, Yanqing; Tanaka, Ryo; Shiono, Takeshi; Cai, Zhengguo
• Journal of publication: Polymer Chemistry
• Year of publication: 2018
• Journal volume: 9
• Journal issue: 45
• Pages of publication: 5476
• a: 8.3132 ± 0.0007 Å
• b: 10.841 ± 0.0009 Å
• c: 12.801 ± 0.0011 Å
• α: 110.224 ± 0.002°
• β: 92.769 ± 0.002°
• γ: 105.358 ± 0.002°
• Cell volume: 1031.34 ± 0.15 ų
• Cell temperature: 130 K
• Ambient diffraction temperature: 130 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0442
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.0746
• Weighted residual factors for all reflections included in the refinement: 0.0787
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No